Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C12H21O12.C6H11O7.Ca |
| Molecular Weight | 592.513 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 13 / 13 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Ca++].OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)C([O-])=O.[H][C@@]1(O[C@H]([C@H](O)CO)[C@H](O)[C@@H](O)C([O-])=O)O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O
InChI
InChIKey=YPCRNBPOUVJVMU-LCGAVOCYSA-L
InChI=1S/C12H22O12.C6H12O7.Ca/c13-1-3(15)10(7(18)8(19)11(21)22)24-12-9(20)6(17)5(16)4(2-14)23-12;7-1-2(8)3(9)4(10)5(11)6(12)13;/h3-10,12-20H,1-2H2,(H,21,22);2-5,7-11H,1H2,(H,12,13);/q;;+2/p-2/t3-,4-,5+,6+,7-,8-,9-,10-,12+;2-,3-,4+,5-;/m11./s1
Approval Year
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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97635-31-9
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY | |||
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31959-85-0
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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SUPERSEDED | |||
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64776
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY | |||
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100000092399
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY | |||
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93H20IU3DN
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY | |||
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DB13142
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY | |||
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DTXSID20953847
Created by
admin on Fri Dec 15 19:15:27 UTC 2023 , Edited by admin on Fri Dec 15 19:15:27 UTC 2023
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PRIMARY |
PARENT (SALT/SOLVATE)
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
